4-[(3S)-4-[2-(7-chloranylindol-1-yl)ethanoyl]-3-methyl-piperazin-1-yl]-N-pyrimidin-4-yl-benzenesulfonamide

Systemtic Name: 4-[(3S)-4-[2-(7-chloranylindol-1-yl)ethanoyl]-3-methyl-piperazin-1-yl]-N-pyrimidin-4-yl-benzenesulfonamide Openeye Name: 4-[(3S)-4-[2-(7-chloroindol-1-yl)acetyl]-3-methyl-piperazin-1-yl]-N-pyrimidin-4-yl-benzenesulfonamide CAS Name: 4-[(3S)-4-[2-(7-chloro-1-indolyl)-1-oxoethyl]-3-methyl-1-piperazinyl]-N-(4-pyrimidinyl)benzenesulfonamide IUPAC Name: 4-[(3S)-4-[2-(7-chloroindol-1-yl)acetyl]-3-methylpiperazin-1-yl]-N-pyrimidin-4-ylbenzenesulfonamide Traditional Name: 4-[(3S)-4-[2-(7-chloroindol-1-yl)acetyl]-3-methyl-piperazino]-N-(4-pyrimidyl)benzenesulfonamide Formula: C25H25ClN6O3S MolecularWeight: 525.0224

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)CN2C=CC3=C2C(=CC=C3)Cl)C4=CC=C(C=C4)S(=O)(=O)NC5=NC=NC=C5

Isomeric SMILES

C[C@H]1CN(CCN1C(=O)CN2C=CC3=C2C(=CC=C3)Cl)C4=CC=C(C=C4)S(=O)(=O)NC5=NC=NC=C5

InChI

InChI=1S/C25H25ClN6O3S/c1-18-15-30(20-5-7-21(8-6-20)36(34,35)29-23-9-11-27-17-28-23)13-14-32(18)24(33)16-31-12-10-19-3-2-4-22(26)25(19)31/h2-12,17-18H,13-16H2,1H3,(H,27,28,29)/t18-/m0/s1